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16245-89-9 | 1H-Imidazole, 1-(2-methylpropyl)-
CAS No: 16245-89-9 Catalog No: AG001T67 MDL No:
Product Description
Catalog Number:
AG001T67
Chemical Name:
1H-Imidazole, 1-(2-methylpropyl)-
CAS Number:
16245-89-9
Molecular Formula:
C7H12N2
Molecular Weight:
124.1836
IUPAC Name:
1-(2-methylpropyl)imidazole
InChI:
InChI=1S/C7H12N2/c1-7(2)5-9-4-3-8-6-9/h3-4,6-7H,5H2,1-2H3
InChI Key:
NPOZBHCPELPGKW-UHFFFAOYSA-N
SMILES:
CC(Cn1cncc1)C
Properties
Complexity:
81
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.1g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
124.187g/mol
Monoisotopic Mass:
124.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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